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Benzamide, 3,5-dinitro-N-methyl-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Benzamide, 3,5-dinitro-N-methyl-
SpectraBase Compound ID ERn4jOiuzfV
InChI InChI=1S/C8H7N3O5/c1-9-8(12)5-2-6(10(13)14)4-7(3-5)11(15)16/h2-4H,1H3,(H,9,12)
InChIKey JFZRLYPCHVXTRQ-UHFFFAOYSA-N
Mol Weight 225.16 g/mol
Molecular Formula C8H7N3O5
Exact Mass 225.03857 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Gzj4o8pbPA
Name Benzamide, 3,5-dinitro-N-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.038570332 u
Formula C8H7N3O5
InChI InChI=1S/C8H7N3O5/c1-9-8(12)5-2-6(10(13)14)4-7(3-5)11(15)16/h2-4H,1H3,(H,9,12)
InChIKey JFZRLYPCHVXTRQ-UHFFFAOYSA-N
Molecular Weight 225.160 g/mol
SMILES C1=C(C=C(C=C1N(=O)=O)N(=O)=O)C(NC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970495